Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 7/20 | 0.34 |
| ▸ | HTR7 | P34969 | 7/20 | 0.34 |
| ▸ | HTR6 | P50406 | 4/20 | 0.34 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.32 |
| ▸ | USP1 | O94782 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | USP8 | P40818 | 1/20 | 0.32 |
| ▸ | OTUB1 | Q96FW1 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | EIF2AK3 | Q9NZJ5 | 1/20 | 0.32 |
| ▸ | INSR | P06213 | 2/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29567015 | 1.00 | HTR1A (0.34) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL26806685 | 1.00 | HTR1A (0.34) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL29566737 | 0.89 | HTR1A (0.35) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL24309248 | 0.89 | HTR1A (0.35) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL29566589 | 0.89 | SCN9A (0.37) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL24309259 | 0.88 | HTR1A (0.38) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL29566441 | 0.88 | HTR1A (0.38) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL24309747 | 0.87 | HTR1A (0.37) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL29567007 | 0.87 | HTR1A (0.37) | HTR1AHTR7HTR6DRD2CDK2 | |
| SCHEMBL29566631 | 0.87 | EGFR (0.38) | HTR1AHTR7HTR6DRD2SCN9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |